[1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol

C7H14N2O — CID 123464749

IUPAC[1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
SMILESCNC12CNCC1C2CO
InChIInChI=1S/C7H14N2O/c1-8-7-4-9-2-5(7)6(7)3-10/h5-6,8-10H,2-4H2,1H3
InChIKeySMOGSVCZDUUMCX-UHFFFAOYSA-N
MW142.20 g/mol
LogP-1.21
Rot. Bonds2

About [1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol

[1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol (PubChem CID 123464749) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is [1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol.

Molecular Properties

Compound Name[1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
PubChem CID123464749
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name[1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol
SMILESCNC12CNCC1C2CO
InChIInChI=1S/C7H14N2O/c1-8-7-4-9-2-5(7)6(7)3-10/h5-6,8-10H,2-4H2,1H3
InChIKeySMOGSVCZDUUMCX-UHFFFAOYSA-N
XLogP-1.21
TPSA44.29 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-1.21
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
The IUPAC name of [1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol (CID 123464749) is [1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol.
What is the SMILES notation for [1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
The canonical SMILES for [1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol is CNC12CNCC1C2CO.
What is the InChIKey of [1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
The InChIKey is SMOGSVCZDUUMCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-8-7-4-9-2-5(7)6(7)3-10/h5-6,8-10H,2-4H2,1H3.
What are the key properties of [1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol?
[1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol has a molecular weight of 142.20 g/mol, XLogP of -1.21, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(methylamino)-3-azabicyclo[3.1.0]hexan-6-yl]methanol is sourced from PubChem (CID 123464749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).